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1-(5-Butyl-2-pyrrolidinylidene)-2-heptanone

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

1-(5-Butyl-2-pyrrolidinylidene)-2-heptanone
SpectraBase Compound ID ISvs15mYLc2
InChI InChI=1S/C15H27NO/c1-3-5-7-9-15(17)12-14-11-10-13(16-14)8-6-4-2/h12-13,16H,3-11H2,1-2H3/b14-12+
InChIKey VIWVMYFGZMYPMC-WYMLVPIESA-N
Mol Weight 237.39 g/mol
Molecular Formula C15H27NO
Exact Mass 237.209264 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 27MbSR7Zy43
Name 1-(5-Butyl-2-pyrrolidinylidene)-2-heptanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 237.209264492 u
Formula C15H27NO
InChI InChI=1S/C15H27NO/c1-3-5-7-9-15(17)12-14-11-10-13(16-14)8-6-4-2/h12-13,16H,3-11H2,1-2H3/b14-12+
InChIKey VIWVMYFGZMYPMC-WYMLVPIESA-N
Molecular Weight 237.387 g/mol
SMILES C1(N\C(CC1)=C/C(=O)CCCCC)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.96006